9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole

C243H150N12S6 — CID 157201190

IUPAC9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c3c4c(-c5ccccc5)cc(-c5ccccc5)cc4n(-c4c(-c5ccccc5)cc(-c5nc(-c6ccc7c(c6)sc6ccccc67)nc(-c6ccc7c(c6)sc6ccccc67)n5)cc4-c4ccccc4)c3c2)cc1.c1ccc(-c2cc(-c3nc(-c4ccc5c(c4)sc4ccccc45)nc(-c4ccc5c(c4)sc4ccccc45)n3)cc(-c3ccccc3)c2-n2c3c(-c4ccccc4)ccc(-c4ccccc4)c3c3c(-c4ccccc4)ccc(-c4ccccc4)c32)cc1.c1ccc(-c2cc3c4cc(-c5ccccc5)c(-c5ccccc5)cc4n(-c4c(-c5ccccc5)cc(-c5nc(-c6ccc7c(c6)sc6ccccc67)nc(-c6ccc7c(c6)sc6ccccc67)n5)cc4-c4ccccc4)c3cc2-c2ccccc2)cc1
InChIInChI=1S/3C81H50N4S2/c1-7-23-51(24-8-1)59-43-66(53-27-11-3-12-28-53)76-70(47-59)85(71-48-60(52-25-9-2-10-26-52)44-67(77(71)76)54-29-13-4-14-30-54)78-68(55-31-15-5-16-32-55)45-61(46-69(78)56-33-17-6-18-34-56)81-83-79(57-39-41-64-62-35-19-21-37-72(62)86-74(64)49-57)82-80(84-81)58-40-42-65-63-36-20-22-38-73(63)87-75(65)50-58;1-7-23-51(24-8-1)64-47-70-71-48-65(52-25-9-2-10-26-52)67(54-29-13-4-14-30-54)50-73(71)85(72(70)49-66(64)53-27-11-3-12-28-53)78-68(55-31-15-5-16-32-55)43-59(44-69(78)56-33-17-6-18-34-56)81-83-79(57-39-41-62-60-35-19-21-37-74(60)86-76(62)45-57)82-80(84-81)58-40-42-63-61-36-20-22-38-75(61)87-77(63)46-58;1-7-23-51(24-8-1)60-43-45-62(53-27-11-3-12-28-53)77-74(60)75-61(52-25-9-2-10-26-52)44-46-63(54-29-13-4-14-30-54)78(75)85(77)76-68(55-31-15-5-16-32-55)47-59(48-69(76)56-33-17-6-18-34-56)81-83-79(57-39-41-66-64-35-19-21-37-70(64)86-72(66)49-57)82-80(84-81)58-40-42-67-65-36-20-22-38-71(65)87-73(67)50-58/h3*1-50H
InChIKeyAQUXNYRCTPHBHM-UHFFFAOYSA-N
MW3430.36 g/mol
LogP68.12
Rot. Bonds30

About 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole

9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole (PubChem CID 157201190) has the molecular formula C243H150N12S6 and a molecular weight of 3430.36 g/mol. Its IUPAC name is 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole.

Molecular Properties

Compound Name9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole
PubChem CID157201190
Molecular FormulaC243H150N12S6
Molecular Weight3430.36 g/mol
Exact Mass3427.04
IUPAC Name9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c3c4c(-c5ccccc5)cc(-c5ccccc5)cc4n(-c4c(-c5ccccc5)cc(-c5nc(-c6ccc7c(c6)sc6ccccc67)nc(-c6ccc7c(c6)sc6ccccc67)n5)cc4-c4ccccc4)c3c2)cc1.c1ccc(-c2cc(-c3nc(-c4ccc5c(c4)sc4ccccc45)nc(-c4ccc5c(c4)sc4ccccc45)n3)cc(-c3ccccc3)c2-n2c3c(-c4ccccc4)ccc(-c4ccccc4)c3c3c(-c4ccccc4)ccc(-c4ccccc4)c32)cc1.c1ccc(-c2cc3c4cc(-c5ccccc5)c(-c5ccccc5)cc4n(-c4c(-c5ccccc5)cc(-c5nc(-c6ccc7c(c6)sc6ccccc67)nc(-c6ccc7c(c6)sc6ccccc67)n5)cc4-c4ccccc4)c3cc2-c2ccccc2)cc1
InChIInChI=1S/3C81H50N4S2/c1-7-23-51(24-8-1)59-43-66(53-27-11-3-12-28-53)76-70(47-59)85(71-48-60(52-25-9-2-10-26-52)44-67(77(71)76)54-29-13-4-14-30-54)78-68(55-31-15-5-16-32-55)45-61(46-69(78)56-33-17-6-18-34-56)81-83-79(57-39-41-64-62-35-19-21-37-72(62)86-74(64)49-57)82-80(84-81)58-40-42-65-63-36-20-22-38-73(63)87-75(65)50-58;1-7-23-51(24-8-1)64-47-70-71-48-65(52-25-9-2-10-26-52)67(54-29-13-4-14-30-54)50-73(71)85(72(70)49-66(64)53-27-11-3-12-28-53)78-68(55-31-15-5-16-32-55)43-59(44-69(78)56-33-17-6-18-34-56)81-83-79(57-39-41-62-60-35-19-21-37-74(60)86-76(62)45-57)82-80(84-81)58-40-42-63-61-36-20-22-38-75(61)87-77(63)46-58;1-7-23-51(24-8-1)60-43-45-62(53-27-11-3-12-28-53)77-74(60)75-61(52-25-9-2-10-26-52)44-46-63(54-29-13-4-14-30-54)78(75)85(77)76-68(55-31-15-5-16-32-55)47-59(48-69(76)56-33-17-6-18-34-56)81-83-79(57-39-41-66-64-35-19-21-37-70(64)86-72(66)49-57)82-80(84-81)58-40-42-67-65-36-20-22-38-71(65)87-73(67)50-58/h3*1-50H
InChIKeyAQUXNYRCTPHBHM-UHFFFAOYSA-N
XLogP68.12
TPSA130.80 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds30
Heavy Atoms261
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003430.36
LogP ≤ 568.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole with MolForge

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Related Compounds

5-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-[1]benzothiolo[3,2-c]carbazole
CID 146281101
7-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-[1]benzothiolo[2,3-b]carbazole
CID 146280998
1-tert-butyl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-3,6-diphenylcarbazole;9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,2,7,8-tetraphenylcarbazole;9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole
CID 160989696
12-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-[1]benzothiolo[2,3-a]carbazole
CID 146280676
2-phenyl-4-[7-(1-phenyldibenzothiophen-3-yl)dibenzothiophen-3-yl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 170378557
9-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole
CID 153301126
9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-3-isocyanocarbazole
CID 153301136
3-carbazol-9-yl-9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-phenylcarbazole
CID 146280378
3-carbazol-9-yl-9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]carbazole;12-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-[1]benzothiolo[2,3-a]carbazole;7-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-[1]benzothiolo[2,3-b]carbazole
CID 164961335
9-[4-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-3,6-diphenylcarbazole
CID 146414212
2-dibenzothiophen-3-yl-4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 138659637
3-tert-butyl-6-carbazol-9-yl-9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]carbazole
CID 146281118

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole?
The IUPAC name of 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole (CID 157201190) is 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole.
What is the SMILES notation for 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole?
The canonical SMILES for 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole is c1ccc(-c2cc(-c3ccccc3)c3c4c(-c5ccccc5)cc(-c5ccccc5)cc4n(-c4c(-c5ccccc5)cc(-c5nc(-c6ccc7c(c6)sc6ccccc67)nc(-c6ccc7c(c6)sc6ccccc67)n5)cc4-c4ccccc4)c3c2)cc1.c1ccc(-c2cc(-c3nc(-c4ccc5c(c4)sc4ccccc45)nc(-c4ccc5c(c4)sc4ccccc45)n3)cc(-c3ccccc3)c2-n2c3c(-c4ccccc4)ccc(-c4ccccc4)c3c3c(-c4ccccc4)ccc(-c4ccccc4)c32)cc1.c1ccc(-c2cc3c4cc(-c5ccccc5)c(-c5ccccc5)cc4n(-c4c(-c5ccccc5)cc(-c5nc(-c6ccc7c(c6)sc6ccccc67)nc(-c6ccc7c(c6)sc6ccccc67)n5)cc4-c4ccccc4)c3cc2-c2ccccc2)cc1.
What is the InChIKey of 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole?
The InChIKey is AQUXNYRCTPHBHM-UHFFFAOYSA-N. The full InChI is InChI=1S/3C81H50N4S2/c1-7-23-51(24-8-1)59-43-66(53-27-11-3-12-28-53)76-70(47-59)85(71-48-60(52-25-9-2-10-26-52)44-67(77(71)76)54-29-13-4-14-30-54)78-68(55-31-15-5-16-32-55)45-61(46-69(78)56-33-17-6-18-34-56)81-83-79(57-39-41-64-62-35-19-21-37-72(62)86-74(64)49-57)82-80(84-81)58-40-42-65-63-36-20-22-38-73(63)87-75(65)50-58;1-7-23-51(24-8-1)64-47-70-71-48-65(52-25-9-2-10-26-52)67(54-29-13-4-14-30-54)50-73(71)85(72(70)49-66(64)53-27-11-3-12-28-53)78-68(55-31-15-5-16-32-55)43-59(44-69(78)56-33-17-6-18-34-56)81-83-79(57-39-41-62-60-35-19-21-37-74(60)86-76(62)45-57)82-80(84-81)58-40-42-63-61-36-20-22-38-75(61)87-77(63)46-58;1-7-23-51(24-8-1)60-43-45-62(53-27-11-3-12-28-53)77-74(60)75-61(52-25-9-2-10-26-52)44-46-63(54-29-13-4-14-30-54)78(75)85(77)76-68(55-31-15-5-16-32-55)47-59(48-69(76)56-33-17-6-18-34-56)81-83-79(57-39-41-66-64-35-19-21-37-70(64)86-72(66)49-57)82-80(84-81)58-40-42-67-65-36-20-22-38-71(65)87-73(67)50-58/h3*1-50H.
What are the key properties of 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole?
9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole has a molecular weight of 3430.36 g/mol, XLogP of 68.12, 30 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-1,4,5,8-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,3,6,7-tetraphenylcarbazole;9-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-2,4,5,7-tetraphenylcarbazole is sourced from PubChem (CID 157201190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).